# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom).
# potential = 2004--Zhou-X-W-Johnson-R-A-Wadley-H-N-G--Cu-Ag-Au-Ni-Pd-Pt-Al-Pb-Fe-Mo-Ta-W-Mg-Co-Ti-Zr
# implementation = 2004--Zhou-X-W--Cu-Ag-Au-Ni-Pd-Pt-Al-Pb-Fe-Mo-Ta-W-Mg-Co-Ti-Zr--LAMMPS--ipr1
# composition = Mo2Ti
# NOTE: These values are for static, unrelaxed structures and use the ideal
# b/a and c/a ratios for the crystal structure, not the potential-specific
# values.

# Calculations from the NIST Interatomic Potential Repository Project:
# http://www.ctcms.nist.gov/potentials/

# Table generated 2024-04-11

r    C1--CaF2--fluori 
0.50  nan             
0.52  nan             
0.54  nan             
0.56  nan             
0.58  nan             
0.60  nan             
0.62  nan             
0.64  nan             
0.66  nan             
0.68  nan             
0.70  nan             
0.72  nan             
0.74  nan             
0.76  nan             
0.78  nan             
0.80  nan             
0.82  nan             
0.84  nan             
0.86  nan             
0.88  nan             
0.90  nan             
0.92  nan             
0.94  nan             
0.96  nan             
0.98  nan             
1.00  nan             
1.02  nan             
1.04  nan             
1.06  nan             
1.08  nan             
1.10  nan             
1.12  nan             
1.14  3.577232690e+02 
1.16  3.296154132e+02 
1.18  3.038222423e+02 
1.20  2.801416040e+02 
1.22  2.583880022e+02 
1.24  2.383908403e+02 
1.26  2.199938630e+02 
1.28  2.030550394e+02 
1.30  1.874451685e+02 
1.32  1.730453968e+02 
1.34  1.597456175e+02 
1.36  1.474448132e+02 
1.38  1.360523756e+02 
1.40  1.254888306e+02 
1.42  1.156852741e+02 
1.44  1.065819333e+02 
1.46  9.812651712e+01 
1.48  9.027268171e+01 
1.50  8.297880099e+01 
1.52  7.620712784e+01 
1.54  6.992321721e+01 
1.56  6.409541657e+01 
1.58  5.869431629e+01 
1.60  5.369216921e+01 
1.62  4.906238498e+01 
1.64  4.477918933e+01 
1.66  4.081744349e+01 
1.68  3.715260450e+01 
1.70  3.376349733e+01 
1.72  3.063255466e+01 
1.74  2.773831177e+01 
1.76  2.506081097e+01 
1.78  2.258207320e+01 
1.80  2.028624013e+01 
1.82  1.815951314e+01 
1.84  1.619000464e+01 
1.86  1.436749129e+01 
1.88  1.268306839e+01 
1.90  1.112874924e+01 
1.92  9.697083994e+00 
1.94  8.380875234e+00 
1.96  7.173028544e+00 
1.98  6.066516393e+00 
2.00  5.054386100e+00 
2.02  4.129752481e+00 
2.04  3.285768533e+00 
2.06  2.515610651e+00 
2.08  1.812518202e+00 
2.10  1.169899395e+00 
2.12  5.814843793e-01 
2.14  4.148938525e-02 
2.16 -4.552432392e-01 
2.18 -9.131578358e-01 
2.20 -1.335967715e+00 
2.22 -1.726708428e+00 
2.24 -2.087845945e+00 
2.26 -2.421413066e+00 
2.28 -2.729144721e+00 
2.30 -3.012587616e+00 
2.32 -3.273170622e+00 
2.34 -3.512234742e+00 
2.36 -3.731037383e+00 
2.38 -3.930748160e+00 
2.40 -4.112449663e+00 
2.42 -4.277087882e+00 
2.44 -4.425283552e+00 
2.46 -4.558169763e+00 
2.48 -4.676868789e+00 
2.50 -4.782379677e+00 
2.52 -4.875585278e+00 
2.54 -4.957256231e+00 
2.56 -5.028055523e+00 
2.58 -5.088543929e+00 
2.60 -5.138955372e+00 
2.62 -5.179129333e+00 
2.64 -5.208931846e+00 
2.66 -5.228203391e+00 
2.68 -5.236863790e+00 
2.70 -5.234915407e+00 
2.72 -5.222440070e+00 
2.74 -5.199593697e+00 
2.76 -5.166599528e+00 
2.78 -5.123741532e+00 
2.80 -5.071330728e+00 
2.82 -5.009645230e+00 
2.84 -4.939027432e+00 
2.86 -4.859911430e+00 
2.88 -4.772831334e+00 
2.90 -4.678430506e+00 
2.92 -4.577468297e+00 
2.94 -4.470820583e+00 
2.96 -4.359470700e+00 
2.98 -4.244488255e+00 
3.00 -4.126994712e+00 
3.02 -4.008116737e+00 
3.04 -3.888930844e+00 
3.06 -3.770405778e+00 
3.08 -3.653351140e+00 
3.10 -3.538380866e+00 
3.12 -3.425897418e+00 
3.14 -3.316098447e+00 
3.16 -3.209001030e+00 
3.18 -3.104478819e+00 
3.20 -3.002303534e+00 
3.22 -2.902185791e+00 
3.24 -2.803811664e+00 
3.26 -2.706873512e+00 
3.28 -2.611094915e+00 
3.30 -2.516250221e+00 
3.32 -2.422179265e+00 
3.34 -2.328797657e+00 
3.36 -2.236102722e+00 
3.38 -2.144174951e+00 
3.40 -2.053174758e+00 
3.42 -1.963334604e+00 
3.44 -1.874946449e+00 
3.46 -1.788345636e+00 
3.48 -1.703891952e+00 
3.50 -1.621949340e+00 
3.52 -1.542865666e+00 
3.54 -1.466953893e+00 
3.56 -1.394475898e+00 
3.58 -1.325629971e+00 
3.60 -1.260542878e+00 
3.62 -1.199267048e+00 
3.64 -1.141782961e+00 
3.66 -1.088006210e+00 
3.68 -1.037798103e+00 
3.70 -9.909782996e-01 
3.72 -9.473379086e-01 
3.74 -9.066517482e-01 
3.76 -8.686888660e-01 
3.78 -8.332208991e-01 
3.80 -8.000282189e-01 
3.82 -7.689040652e-01 
3.84 -7.396570015e-01 
3.86 -7.121120607e-01 
3.88 -6.861109292e-01 
3.90 -6.615114676e-01 
3.92 -6.381868032e-01 
3.94 -6.160241758e-01 
3.96 -5.949236671e-01 
3.98 -5.747969048e-01 
4.00 -5.555657968e-01 
4.02 -5.371613428e-01 
4.04 -5.195225352e-01 
4.06 -5.025952284e-01 
4.08 -4.863312690e-01 
4.10 -4.706882460e-01 
4.12 -4.556285839e-01 
4.14 -4.411182268e-01 
4.16 -4.271266801e-01 
4.18 -4.136264405e-01 
4.20 -4.005926135e-01 
4.22 -3.880025785e-01 
4.24 -3.758356974e-01 
4.26 -3.640730614e-01 
4.28 -3.526972739e-01 
4.30 -3.416922627e-01 
4.32 -3.310431185e-01 
4.34 -3.207359567e-01 
4.36 -3.107577981e-01 
4.38 -3.010964668e-01 
4.40 -2.917405018e-01 
4.42 -2.826790820e-01 
4.44 -2.739019600e-01 
4.46 -2.653994068e-01 
4.48 -2.571621625e-01 
4.50 -2.491813943e-01 
4.52 -2.414486600e-01 
4.54 -2.339558760e-01 
4.56 -2.266952894e-01 
4.58 -2.196594539e-01 
4.60 -2.128412077e-01 
4.62 -2.062336547e-01 
4.64 -1.998301475e-01 
4.66 -1.936242717e-01 
4.68 -1.876098330e-01 
4.70 -1.817808435e-01 
4.72 -1.761315114e-01 
4.74 -1.706562296e-01 
4.76 -1.653495664e-01 
4.78 -1.602062561e-01 
4.80 -1.552211344e-01 
4.82 -1.503893634e-01 
4.84 -1.457060583e-01 
4.86 -1.411665349e-01 
4.88 -1.367662352e-01 
4.90 -1.325007201e-01 
4.92 -1.283656615e-01 
4.94 -1.243568358e-01 
4.96 -1.204701161e-01 
4.98 -1.167014650e-01 
5.00 -1.130469268e-01 
5.02 -1.095026201e-01 
5.04 -1.060647298e-01 
5.06 -1.027294989e-01 
5.08 -9.949322001e-02 
5.10 -9.635222713e-02 
5.12 -9.330288640e-02 
5.14 -9.034158720e-02 
5.16 -8.746473290e-02 
5.18 -8.466873148e-02 
5.20 -8.194998622e-02 
5.22 -7.930488658e-02 
5.24 -7.672979938e-02 
5.26 -7.422106078e-02 
5.28 -7.177496920e-02 
5.30 -6.938777981e-02 
5.32 -6.705570058e-02 
5.34 -6.477489272e-02 
5.36 -6.254147395e-02 
5.38 -6.035152600e-02 
5.40 -5.820110860e-02 
5.42 -5.608628093e-02 
5.44 -5.400313197e-02 
5.46 -5.194782125e-02 
5.48 -4.991663166e-02 
5.50 -4.790603542e-02 
5.52 -4.591277422e-02 
5.54 -4.393395444e-02 
5.56 -4.196715222e-02 
5.58 -4.001053323e-02 
5.60 -3.806297868e-02 
5.62 -3.612421131e-02 
5.64 -3.419491339e-02 
5.66 -3.227682604e-02 
5.68 -3.037281787e-02 
5.70 -2.848690990e-02 
5.72 -2.662424502e-02 
5.74 -2.479099273e-02 
5.76 -2.299418055e-02 
5.78 -2.124125520e-02 
5.80 -1.954017620e-02 
5.82 -1.789905622e-02 
5.84 -1.632565175e-02 
5.86 -1.482701913e-02 
5.88 -1.340920714e-02 
5.90 -1.207701026e-02 
5.92 -1.083380023e-02 
5.94 -9.681444822e-03 
5.96 -8.620313378e-03 
5.98 -7.649360550e-03 
6.00 -6.766273187e-03